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CHEBI:214261 - Pochonin P

ChEBI IDCHEBI:214261
ChEBI NamePochonin P
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC18H19ClO7
Net Charge0
Average Mass382.796
Monoisotopic Mass382.08193
SMILESC[C@@H]1C[C@@H]2O[C@@H]2C[C@H](O)/C=C/C(O)=C\c2c(Cl)c(O)cc(O)c2C(=O)O1
InChIInChI=1S/C18H19ClO7/c1-8-4-14-15(26-14)6-10(21)3-2-9(20)5-11-16(18(24)25-8)12(22)7-13(23)17(11)19/h2-3,5,7-8,10,14-15,20-23H,4,6H2,1H3/b3-2+,9-5+/t8-,10-,14+,15-/m1/s1
InChIKeyNZMLRMZZFPSQHJ-LIWZNPAKSA-N
Species of MetaboliteComponentSourceComments
Pochonia (ncbitaxon:243023) - DOI (10.1016/j.tet.2009.02.027)
Roles Classification
Chemical Role:
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
ChEBI Ontology
Outgoing Relation(s)
Pochonin P (CHEBI:214261) is a hydroxybenzoic acid (CHEBI:24676)
IUPAC Name 
(4R,6S,8R,10S,11E,13E)-16-chloro-10,13,17,19-tetrahydroxy-4-methyl-3,7-dioxatricyclo[13.4.0.06,8]nonadeca-1(15),11,13,16,18-pentaen-2-one
Manual XrefsDatabases
78437511ChemSpider